Hexanoyl chloride, 2-(2,4-bis(1,1-dimethylpropyl)phenoxy)-
TL;DR: Hexanoyl chloride, 2-(2,4-bis(1,1-dimethylpropyl)phenoxy)- (CAS 63059-55-2) is a chemical compound with molecular formula C22H35ClO2 and molecular weight 366.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2,4-bis(2-methylbutan-2-yl)phenoxy]hexanoyl chloride
Also Known As: 2-(2,4-Di-tert-pentylphenoxy)hexanoyl chloride, 2-[2,4-di-tert-pentylphenoxy]hexanoylchloride, 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]hexanoyl chloride, 2-[2,4-Di-tert-pentylphenoxy]hexanoyl chloride, 2-(2,4-di-t-pentylphenoxy)hexanoyl chloride
| Molecular Formula | C22H35ClO2 |
|---|---|
| Molecular Weight | 366.23 g/mol |
| LogP | 8.7 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Exact Mass | 366.23254 |
| Heavy Atoms | 25 |
| Complexity | 416.0 |
Chemical Identifiers
| CAS Number | 63059-55-2 |
|---|---|
| SMILES | CCCCC(C(=O)Cl)OC1=C(C=C(C=C1)C(C)(C)CC)C(C)(C)CC |
| InChIKey | LRKLDHJJKJBSIP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Hexanoyl chloride, 2-(2,4-bis(1,1-dimethylpropyl)phenoxy)- (CAS 63059-55-2), with molecular formula C22H35ClO2 and molecular weight 366.23 g/mol. IUPAC: 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]hexanoyl chloride.
Chemical Property Profile of Hexanoyl chloride, 2-(2,4-bis(1,1-dimethylpropyl)phenoxy)-
Property Insights of Hexanoyl chloride, 2-(2,4-bis(1,1-dimethylpropyl)phenoxy)-
The XLogP value of 8.7 indicates that Hexanoyl chloride, 2-(2,4-bis(1,1-dimethylpropyl)phenoxy)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Hexanoyl chloride, 2-(2,4-bis(1,1-dimethylpropyl)phenoxy)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexanoyl chloride, 2-(2,4-bis(1,1-dimethylpropyl)phenoxy)- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Hexanoyl chloride, 2-(2,4-bis(1,1-dimethylpropyl)phenoxy)-?
The CAS number of Hexanoyl chloride, 2-(2,4-bis(1,1-dimethylpropyl)phenoxy)- is 63059-55-2.
What is the molecular formula of Hexanoyl chloride, 2-(2,4-bis(1,1-dimethylpropyl)phenoxy)-?
The molecular formula of Hexanoyl chloride, 2-(2,4-bis(1,1-dimethylpropyl)phenoxy)- is C22H35ClO2.
What is the molecular weight of Hexanoyl chloride, 2-(2,4-bis(1,1-dimethylpropyl)phenoxy)-?
The molecular weight of Hexanoyl chloride, 2-(2,4-bis(1,1-dimethylpropyl)phenoxy)- is 366.23 g/mol.
Where can I buy Hexanoyl chloride, 2-(2,4-bis(1,1-dimethylpropyl)phenoxy)-?
You can request a quote for Hexanoyl chloride, 2-(2,4-bis(1,1-dimethylpropyl)phenoxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexanoyl chloride, 2-(2,4-bis(1,1-dimethylpropyl)phenoxy)-?
Yes, KEHONG BIO provides custom synthesis services for Hexanoyl chloride, 2-(2,4-bis(1,1-dimethylpropyl)phenoxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.